ID: 125749
SMILES:c1(O)c2c(c(C3C=C(C)CCC3C(C)=C)c(O)c1CO)OC(c1c(O)c(C)cc(O)c1)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.547
CB1 binding score: -14.924
InChIKey:POIVAQNGDUNHRM-UHFFFAOYSA-N
ID: 125750
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 125751
SMILES:COC1(C)C(O)COc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -16.941
InChIKey:GKLPCIKOSQFENV-UHFFFAOYSA-N
ID: 125752
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 125753
SMILES:C(CO)C1=C(C)CC(OC(=O)C2(C)Oc3cc(CCCCC)cc(OC)c3C=C2)c(CC=C(C)CCC=C(C)C)c1C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 604.828
CB1 binding score: -13.856
InChIKey:WQAHERHCHIKNRO-UHFFFAOYSA-N
ID: 125754
SMILES:O=C1C(C)=CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.38
InChIKey:GUIDIBWECSMDDB-UHFFFAOYSA-N
ID: 125755
SMILES:c1c(O)c(CC=C(C)C)c(O)cc1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 125756
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)(=CCCc1cccc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -14.571
InChIKey:PJDNJILCSHAEDM-UHFFFAOYSA-N
ID: 125757
SMILES:C1(C)(C)Oc2c(C)cc(O)c3c2C1C=C(C(C)=C)C(C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -14.804
InChIKey:NELHRARFBQVYOI-UHFFFAOYSA-N
ID: 125758
SMILES:C1C2C(C(C)(C)Oc3cc(CCC=C(C)C)ccc32)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.615
InChIKey:HWVJHRPKJUCOQQ-UHFFFAOYSA-N
ID: 125759
SMILES:C(C(CCC=C(C)C)C)CCC1(C)Oc2cc(C)cc(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.02
InChIKey:RJPFOAKSSZMZDF-UHFFFAOYSA-N
ID: 125760
SMILES:O=C1C(O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.334
InChIKey:JJZRTZNLMMWBAH-UHFFFAOYSA-N
ID: 125761
SMILES:C1CC(C)C(C)(CC=C(C=O)CC2c3c(O)cc(C)cc3O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.381
InChIKey:RSFFMFIXMASKMW-UHFFFAOYSA-N
ID: 125762
SMILES:C1(C)CCC(C(C)=C)C2c3c(O)cc(C)cc3OC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.321
InChIKey:JVQPKFBGDJGBJI-UHFFFAOYSA-N
ID: 125763
SMILES:C(C)(O)(C)C1Oc2c(c(OC)cc(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.522
InChIKey:MMKUTXQSJFJAAU-UHFFFAOYSA-N
ID: 125764
SMILES:Oc1c(CC=C(CCC2(C)CC=CCC2C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -14.347
InChIKey:FOVVZHVAOSWPNM-UHFFFAOYSA-N
ID: 125765
SMILES:c12c(CC=C(C)C)c(O)cc(CCCCC)c1C1(C=O)CC(=O)C(C)(C)C1C(C(C)C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.929
InChIKey:TVMVVEBKYPWRQL-UHFFFAOYSA-N
ID: 125766
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125767
SMILES:C1C2(C)Oc3c(c(OC(C)=O)cc(CCCCC)c3)CC2C(C(C)CCC=C(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.343
InChIKey:QJQLIMPBRZEWBB-UHFFFAOYSA-N
ID: 125768
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 125769
SMILES:c12c(c(O)cc(=O)c(Cl)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.789
CB1 binding score: -13.118
InChIKey:RXZZGZDQQKJRHR-UHFFFAOYSA-N